4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane

C15H24OSi — CID 139921336

IUPAC4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane
SMILESC=Cc1ccc(CCCC[Si](C)(C)OC)cc1
InChIInChI=1S/C15H24OSi/c1-5-14-9-11-15(12-10-14)8-6-7-13-17(3,4)16-2/h5,9-12H,1,6-8,13H2,2-4H3
InChIKeyVACCLHOROCTBMQ-UHFFFAOYSA-N
MW248.44 g/mol
LogP4.50
Rot. Bonds7

About 4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane

4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane (PubChem CID 139921336) has the molecular formula C15H24OSi and a molecular weight of 248.44 g/mol. Its IUPAC name is 4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane.

Molecular Properties

Compound Name4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane
PubChem CID139921336
Molecular FormulaC15H24OSi
Molecular Weight248.44 g/mol
Exact Mass248.16
IUPAC Name4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane
SMILESC=Cc1ccc(CCCC[Si](C)(C)OC)cc1
InChIInChI=1S/C15H24OSi/c1-5-14-9-11-15(12-10-14)8-6-7-13-17(3,4)16-2/h5,9-12H,1,6-8,13H2,2-4H3
InChIKeyVACCLHOROCTBMQ-UHFFFAOYSA-N
XLogP4.50
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.44
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane?
The IUPAC name of 4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane (CID 139921336) is 4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane.
What is the SMILES notation for 4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane?
The canonical SMILES for 4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane is C=Cc1ccc(CCCC[Si](C)(C)OC)cc1.
What is the InChIKey of 4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane?
The InChIKey is VACCLHOROCTBMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24OSi/c1-5-14-9-11-15(12-10-14)8-6-7-13-17(3,4)16-2/h5,9-12H,1,6-8,13H2,2-4H3.
What are the key properties of 4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane?
4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane has a molecular weight of 248.44 g/mol, XLogP of 4.50, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane is sourced from PubChem (CID 139921336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).